4-[1-Allyl-7-(Trifluoromethyl)-1H-Indazol-3-Yl]-1,3-Benzenediol

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Properties Simple | Detailed

Formula C17H13F3N2O2
IUPAC Name 4-[1-allyl-7-(trifluoromethyl)indazol-1-ium-3-yl]benzene-1,3-diol
Molecular Mass 334.293 g·mol−1
Heat of Formation -624.4 ± 16.7 kJ·mol−1
Dipole Moment 1.21 ± 1.08 D
Volume 358.23 Å 3
Surface Area 313.38 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry C1
InChIKey ZDUDMCQPFKPISO-UHFFFAOYSA-N
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